2,5-bis(chloranyl)-3-ethoxycarbonyl-pyridine-4-sulfonic acid

Systemtic Name: 2,5-bis(chloranyl)-3-ethoxycarbonyl-pyridine-4-sulfonic acid Openeye Name: 2,5-dichloro-3-ethoxycarbonyl-pyridine-4-sulfonic acid CAS Name: 2,5-dichloro-3-ethoxycarbonyl-4-pyridinesulfonic acid IUPAC Name: 2,5-dichloro-3-ethoxycarbonylpyridine-4-sulfonic acid Traditional Name: 3-carbethoxy-2,5-dichloro-pyridine-4-sulfonic acid Formula: C8H7Cl2NO5S MolecularWeight: 300.11588

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=CN=C1Cl)Cl)S(=O)(=O)O

Isomeric SMILES

CCOC(=O)C1=C(C(=CN=C1Cl)Cl)S(=O)(=O)O

InChI

InChI=1S/C8H7Cl2NO5S/c1-2-16-8(12)5-6(17(13,14)15)4(9)3-11-7(5)10/h3H,2H2,1H3,(H,13,14,15)